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CAS 131515-53-2

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Methyl 3-(4-cyanophenyl)bicyclo[1.1.1]pentane-1-carboxylate

Description:
Methyl 3-(4-cyanophenyl)bicyclo[1.1.1]pentane-1-carboxylate is a chemical compound characterized by its bicyclic structure, which consists of a bicyclo[1.1.1]pentane core substituted with a carboxylate group and a cyanophenyl moiety. The presence of the methyl ester functional group indicates that it can undergo hydrolysis to yield the corresponding carboxylic acid. The cyanophenyl group introduces a polar functional group, which can influence the compound's solubility and reactivity. This compound may exhibit interesting properties such as potential biological activity or utility in organic synthesis, particularly in the development of pharmaceuticals or agrochemicals. Its unique structure may also contribute to specific interactions in biological systems or materials science applications. As with many organic compounds, its stability, reactivity, and potential applications would depend on the specific conditions under which it is used, including temperature, solvent, and the presence of other reagents.
Formula:C14H13NO2
InChI:InChI=1S/C14H13NO2/c1-17-12(16)14-7-13(8-14,9-14)11-4-2-10(6-15)3-5-11/h2-5H,7-9H2,1H3
InChI key:InChIKey=JMGWGCNWORKLBM-UHFFFAOYSA-N
SMILES:C(OC)(=O)C12CC(C1)(C2)C3=CC=C(C#N)C=C3
Synonyms:
  • Methyl 3-(4-cyanophenyl)bicyclo[1.1.1]pentane-1-carboxylate
  • Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-(4-cyanophenyl)-, methyl ester
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